Compound Detail
CHEMBL3220943
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3220943 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OKBNPTSVHSNLFJ-RGEXLXHISA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
392.5
MW (Da)
4.28
ALogP
5
HBA
0
HBD
59.0
PSA (Ų)
0.44
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.19
Ki 1 meas. best 5.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 2 CHEMBL253 | Ki | 5.59 | 5.59 | 2580.0 | 1 |
| N-arachidonyl glycine receptor CHEMBL2384898 | IC50 | 5.19 | 5.19 | 6450.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 2 | Ki | = | 2580.0 | nM | 5.59 | Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HE... | - |
| N-arachidonyl glycine receptor | IC50 | = | 6450.0 | nM | 5.19 | Antagonist activity against human GPR18 expressed in CHO cells assessed as reduc... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C3MD00394A | Cannabinoid receptor 1 | 4 |
| - | 10.1039/C3MD00394A | G-protein coupled receptor 55 | 3 |
| - | 10.1039/C3MD00394A | N-arachidonyl glycine receptor | 2 |
| - | 10.1039/C3MD00394A | Cannabinoid receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine